MC25: An Accurate Meta Pair-Density Functional for Multiconfiguration Pair-Density Functional Theory and Linearized Pair-Density Functional Theory

Full Citation

D. Zhang, Y. Kim, M. R. Hennefarth, L. Gagliardi, and D. G. Truhlar, MC25: An Accurate Meta Pair-Density Functional for Multiconfiguration Pair-Density Functional Theory and Linearized Pair-Density Functional Theory, J. Chem. Theory Comput., 2025. DOI: 10.1021/acs.jctc.5c01321